2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol

C11H15NO2 — CID 55262268

IUPAC2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol
SMILESCOCc1ccc(O)c([C@H]2CCN2)c1
InChIInChI=1S/C11H15NO2/c1-14-7-8-2-3-11(13)9(6-8)10-4-5-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1
InChIKeyRKCGNFIKMYKLTR-SNVBAGLBSA-N
MW193.25 g/mol
LogP1.57
Rot. Bonds3

About 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol

2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol (PubChem CID 55262268) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol.

Molecular Properties

Compound Name2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol
PubChem CID55262268
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol
SMILESCOCc1ccc(O)c([C@H]2CCN2)c1
InChIInChI=1S/C11H15NO2/c1-14-7-8-2-3-11(13)9(6-8)10-4-5-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1
InChIKeyRKCGNFIKMYKLTR-SNVBAGLBSA-N
XLogP1.57
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

4-(2-methoxyethyl)-2-[(2S)-pyrrolidin-2-yl]phenol
CID 66519378
2-[(2S)-azetidin-2-yl]-4-methoxyphenol;hydrochloride
CID 171196735
2-[(2R)-azetidin-2-yl]-4-ethoxyphenol
CID 55263715
methyl 2-[4-hydroxy-3-[(2R)-pyrrolidin-2-yl]phenyl]acetate
CID 66519346
2-[(2S)-azetidin-2-yl]-4-fluorophenol
CID 55277686
4-amino-2-[(2R)-azetidin-2-yl]phenol
CID 131014546
4-methoxy-2-[(2S)-piperidin-2-yl]phenol
CID 131531573
4-methoxy-2-[(2R)-piperidin-2-yl]phenol
CID 131513044
2-(azetidin-2-yl)phenol
CID 55282316
2-[(1R)-1-aminoethyl]-4-(methoxymethyl)phenol
CID 55262532
4-(methoxymethyl)-2-(piperazin-1-ylmethyl)phenol
CID 83897174
2-(1-aminopropan-2-yl)-4-(methoxymethyl)phenol
CID 83879401

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol?
The IUPAC name of 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol (CID 55262268) is 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol.
What is the SMILES notation for 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol?
The canonical SMILES for 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol is COCc1ccc(O)c([C@H]2CCN2)c1.
What is the InChIKey of 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol?
The InChIKey is RKCGNFIKMYKLTR-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15NO2/c1-14-7-8-2-3-11(13)9(6-8)10-4-5-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1.
What are the key properties of 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol?
2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol has a molecular weight of 193.25 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-azetidin-2-yl]-4-(methoxymethyl)phenol is sourced from PubChem (CID 55262268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).